propyl N'-(2-azanyl-1,3-benzothiazol-6-yl)carbamimidothioate

Systemtic Name: propyl N'-(2-azanyl-1,3-benzothiazol-6-yl)carbamimidothioate Openeye Name: 3-(2-amino-1,3-benzothiazol-6-yl)-2-propyl-isothiourea CAS Name: N'-(2-amino-1,3-benzothiazol-6-yl)carbamimidothioic acid propyl ester IUPAC Name: propyl N'-(2-amino-1,3-benzothiazol-6-yl)carbamimidothioate Traditional Name: 3-(2-amino-1,3-benzothiazol-6-yl)-2-propyl-isothiourea Formula: C11H14N4S2 MolecularWeight: 266.38566

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=NC1=CC2=C(C=C1)N=C(S2)N)N

Isomeric SMILES

CCCSC(=NC1=CC2=C(C=C1)N=C(S2)N)N

InChI

InChI=1S/C11H14N4S2/c1-2-5-16-10(12)14-7-3-4-8-9(6-7)17-11(13)15-8/h3-4,6H,2,5H2,1H3,(H2,12,14)(H2,13,15)